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32973-53-8 | 2-(1-PHENYL-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-ETHANOL
CAS No: 32973-53-8 Catalog No: AG00CJ3L MDL No:
Product Description
Catalog Number:
AG00CJ3L
Chemical Name:
2-(1-PHENYL-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-ETHANOL
CAS Number:
32973-53-8
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
2-(1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)ethanol
InChI:
InChI=1S/C17H19NO/c19-13-12-18-11-10-14-6-4-5-9-16(14)17(18)15-7-2-1-3-8-15/h1-9,17,19H,10-13H2
InChI Key:
AFOUAOIZHNGJNH-UHFFFAOYSA-N
SMILES:
OCCN1CCc2c(C1c1ccccc1)cccc2
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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